Effect of Mineralogical Changes on Mechanical Properties of Well Cement

Total Page:16

File Type:pdf, Size:1020Kb

Effect of Mineralogical Changes on Mechanical Properties of Well Cement ARMA 19–1981 Well integrity of high temperature wells: Effect of mineralogical changes on mechanical properties of well cement TerHeege, J.H. and Wollenweber, J. TNO Applied Geosciences, Utrecht, the Netherlands Marcel Naumann Downloaded from http://onepetro.org/ARMAUSRMS/proceedings-pdf/ARMA19/All-ARMA19/ARMA-2019-1981/1133466/arma-2019-1981.pdf/1 by guest on 02 October 2021 Equinor ASA, Sandsli, Norway Pipilikaki, P. TNO Structural Reliability, Delft, the Netherlands Vercauteren, F. TNO Material Solutions, Eindhoven, the Netherlands This paper w as prepared for presentation at the 53rd US Rock Mechanics/Geomechanics Symposium held in New Y ork, NY , USA , 23–26 June 2019. This paper w as selected for presentation at the symposium by an ARMA Technical Program Committee based on a technical and critical review of the paper by a minimum of tw o technical reviewers. The material, as presented, does not necessarily reflect any position of ARMA, its of ficers, or members. ABSTRACT: Wells used for steam-assisted gravity drainage (SAGD), for cyclic steam stimulation (CSS), for hydrocarbon production in areas with anomalous high geothermal gradient, or for geothermal energy extraction all are operated in high temperature environments where maintaining long term wellbore integrity is one of the key challenges. Changes in cement mineralogy and associated mechanical properties may critically affect the integrity of high temperature wells. In this study, the relation between changes in mineralogy and mechanical properties of API class G cement with 40% silica flour was investigated by exposing samples for 1-4 weeks to temperatures of 60-420°C. The effect of mineralogical changes on mechanical properties was investigated using a combination of chemical and microstructural analysis and triaxial strength tests at confining pressures of 2-15 MPa. The combined effect of changing porosity, microstructure and strength of mineral phases determines changes in mechanical behavior, in particular the formation of stronger mineral phases with higher density affect Young’s modulus, failure strength and residual strength. Deformation of the cement is more brittle at low confining pressures and more ductile at high confining pressures with a considerable residual strength after failure and highest reduction in cement stiffness and increase in strength at temperatures of ~250°C. high pressure (HP) wells (Enform, 2012; Chartier et al., 2015). For standard curing conditions, hydration of 1. INTRODUCTION ordinary Portland cement (OPC, e.g., class G well Wells that are drilled or operated in high temperature cement) with a calcium oxide to silicon dioxide (C/S) environments can be subject to higher risks of losing ratio close to 3.1 produces the amorphous C-S-H and the integrity and zonal isolation. Examples of such high crystalline Ca(OH)2. The product is a mixture of ordered temperature wells include wells used for steam-assisted and disordered phases with C-S-H present as a highly gravity drainage (SAGD) or for cyclic steam stimulation disordered version of the crystalline tobermorite and (CSS), wells drilled in areas with anomalous high jennite phases (Taylor, 1990). Tobermorite preserves high geothermal gradient (HPHT wells), or geothermal wells compressive strength and low permeability. (Stiles, 2006; Chartier et al., 2015; Frioleiffson et al., Mineralogical and mechanical changes are expected to 2015). Maintaining long term wellbore integrity in these occur in OPC above ~110°C (Thorvaldson et al., 1938; situations is one of the key challenges determining the Patchen, 1960; Taylor, 1990; Kyritsis et al., 2009). technical and commercial success of projects that require Reactions result in different hydration products, i.e. wells to operate at high temperatures. crystallization of alpha dicalcium silicate hydrate (α- C SH or Ca SiO (OH) ) is favored. The lime-rich alpha- Changes in cement mineralogy and associated mechanical 2 2 3 2 dicalcium silicate hydrate (α-C SH) is denser than the properties critically affect the integrity of high 2 temperature wells. Standard cement formulations have usual calcium silicate hydrate (C-S-H gel) product. Bulk been reported to reach their mechanical and chemical volume decrease, and cement shrinkage or porosity increase is associated with this reaction, which results in (stability) limits due to the harsh conditions and extreme a decrease in cement strength and increase in permeability cyclic temperature loads in high temperature (HT) and (Patchen, 1960; Pernites and Santra, 2016). All types of findings aid in assessing risks of well integrity loss and OPC and other types of well cements with simila r mitigation of these risks by designing new cement composition show lower strengths when cured above formulations. The main challenge remains to optimize 110°C, compared to curing at 93°C. cement properties for prolonging the integrity of cement at high temperatures while maintaining low viscosity of Elevated curing temperatures are commonly reached by cement slurry during well cementation. SAGD, CCS, HPHT oil and gas wells or geothermal wells in areas with moderate to high geothermal gradients. Changes in cement properties need to be accounted for in 2. EXPERIMENTAL APPROACH the design of cement formulations as well as cementation 2.1. Sample material procedures of these wells to ensure the plugging of loss Downloaded from http://onepetro.org/ARMAUSRMS/proceedings-pdf/ARMA19/All-ARMA19/ARMA-2019-1981/1133466/arma-2019-1981.pdf/1 by guest on 02 October 2021 zones during drilling, proper anchoring, corrosion Synthetic cement samples, Dyckerhoff HT Basic Blend of protection of casing strings, zonal isolation and well cement clinker (API class G cement) with 40 % silica integrity at elevated temperatures and pressures (HPHT flour was used as a starting material (Papaioannou, 2018). conditions). A common practice is to use Portland-type Specimens are prepared using the Dyckerhoff blend and cements with added silica (such as fly ash, silica fume or demineralized water with a water to solid (cement + silica quartz flour) to stabilize cement at higher temperature. flour ) ratio of 0.371 (m/m). For the mixing process, the EN 196-3 protocol was followed. After each step the Reactions of Ca(OH)2 with added silica at elevated temperatures result in a C-S-H with a lower C/S ratio. weight of the samples was checked for dehydration. After Addition of 35 to 40% by weight of cement is enough to mixing, the slurry was injected into cylindrical molds with 25 mm internal diameter and 60 mm length using a prevent the reaction forming α-C2SH. Instead, cement phases such as tobermorite or xonotlite are formed 10 ml syringe in order to achieve homogeneity and (Patchen, 1960). Moreover, for a water to solids ratio of minimize air entrapment. The molds were subsequently 0.4, a formulation with added silica results in 91% of the sealed to prevent water evaporation, and exposed for 72 water being chemically bound against only 39 % of the hours at 60°C and atmospheric pressure in a furnace. available water in the OPC. Addition of ~40% silica flour Samples exposed to 120, 250 and 420°C were thereby favors formation of high strength and low subsequently cooled down for 2 hours before demolding. permeability mineral phases. Pressure resistant glass bottles were used for exposure of pairs of samples under suspension of water at 120°C and Despite the importance for well integrity of high 2 bar in a furnace. Metal sample holders sealed by a cap temperature wells, data on mineralogical and mechanical with two different types of O-rings were used with a pre- changes during exposure of well cements to HPHT defined amount of water to obtain required exposure conditions is limited. Some relevant laboratory studies are conditions. Samples exposed to 60 and 120°C were available (Taylor 1990; Gabrovšek et al., 1993; Meller et cooled down in two hours, while for samples exposed to al., 2009; Pernites and Santra, 2016), but investigations of 250 and 420°C samples a 3 day gradual cooling protocol the relation between mineralogical and mechanical was applied. For mineralogical and microstructural changes at different exposure times and temperatures are analysis, samples were exposed for 4 weeks to 60, 120, sparse. In this study, the relation between changes in 250 and 420°C. For the triaxial experiments, samples mineralogy and mechanical properties of API class G were cut and manually polished to obtain samples with cement with 40% silica flour was investigated. Samples plane parallel surfaces, a final length between 49.6 and were exposed to temperatures of 60°C (curing only) up to 52.2 mm, and a final diameter between 24.6 and 25.0 mm. 420°C (curing and exposure) for exposure times of 3 days Samples were tested after curing (“cured only” samples), (curing time) to 4 weeks (HT exposure). The effect of or after exposure of 1 week to 120°C at 2 bars, 4 weeks to mineralogical changes on mechanical properties was 250°C at 40 bars, and 2 weeks to 420°C at 350 bars, investigated using a combination of (1) chemical analysis respectively. using X-ray diffraction (XRD), (2) microstructural 2.2. Mineralogical and microstructural analysis analysis using scanning electron microscopy (SEM) and optical microscopy, and (3) mechanical properties Analysis of mineral phases in the samples was performed (Young’s modulus, failure stress, residual stress) using using X-ray diffraction (XRD) and energy dispersive X- ray spectroscopy (EDX). Microstructural analysis was triaxial tests at confining pressures of 2-15 MPa. performed using optical microscopy and scanning Results show that the formation of high temperature electron microscopy (SEM). mineral phases in the cement such as tobermorite, xonotlite and wollastonite is associated with marked XRD analysis was performed on grinded aliquots to changes in elastic properties and failure behavior. Critica l access the crystalline compounds and deterioration conditions for the changes in mechanical behavior are products.
Recommended publications
  • Phillipsite and Al-Tobermorite Mineral Cements Produced Through Low-Temperature Water-Rock Reactions in Roman Marine Concrete Sean R
    Western Washington University Western CEDAR Geology Faculty Publications Geology 2017 Phillipsite and Al-tobermorite Mineral Cements Produced through Low-Temperature Water-Rock Reactions in Roman Marine Concrete Sean R. Mulcahy Western Washington University, [email protected] Marie D. Jackson University of Utah, Salt Lake City Heng Chen Southeast University, Nanjing Yao Li Xi'an Jiaotong University, Xi'an Piergiulio Cappelletti Università degli Studi di Napoli Federico II, Naples See next page for additional authors Follow this and additional works at: https://cedar.wwu.edu/geology_facpubs Part of the Geology Commons Recommended Citation Mulcahy, Sean R.; Jackson, Marie D.; Chen, Heng; Li, Yao; Cappelletti, Piergiulio; and Wenk, Hans-Rudolf, "Phillipsite and Al- tobermorite Mineral Cements Produced through Low-Temperature Water-Rock Reactions in Roman Marine Concrete" (2017). Geology Faculty Publications. 67. https://cedar.wwu.edu/geology_facpubs/67 This Article is brought to you for free and open access by the Geology at Western CEDAR. It has been accepted for inclusion in Geology Faculty Publications by an authorized administrator of Western CEDAR. For more information, please contact [email protected]. Authors Sean R. Mulcahy, Marie D. Jackson, Heng Chen, Yao Li, Piergiulio Cappelletti, and Hans-Rudolf Wenk This article is available at Western CEDAR: https://cedar.wwu.edu/geology_facpubs/67 American Mineralogist, Volume 102, pages 1435–1450, 2017 Phillipsite and Al-tobermorite mineral cements produced through low-temperature k water-rock reactions in Roman marine concrete MARIE D. JACKSON1,*, SEAN R. MULCAHY2, HENG CHEN3, YAO LI4, QINFEI LI5, PIERGIULIO CAppELLETTI6, 7 AND HANS-RUDOLF WENK 1Department of Geology and Geophysics, University of Utah, Salt Lake City, Utah 84112, U.S.A.
    [Show full text]
  • Atomistic Modeling of Crystal Structure of Ca1.67Sihx
    Cement and Concrete Research 67 (2015) 197–203 Contents lists available at ScienceDirect Cement and Concrete Research journal homepage: http://ees.elsevier.com/CEMCON/default.asp Atomistic modeling of crystal structure of Ca1.67SiHx Goran Kovačević a, Björn Persson a, Luc Nicoleau b, André Nonat c, Valera Veryazov a,⁎ a Theoretical Chemistry, P.O.B. 124, Lund University, Lund 22100, Sweden b BASF Construction Solutions GmbH, Advanced Materials & Systems Research, Albert Frank Straße 32, 83304 Trostberg, Germany c Laboratoire Interdisciplinaire Carnot de Bourgogne, UMR 6303 CNRS-Université de Bourgogne, BP 47870, F-21078 Dijon Cedex, France article info abstract Article history: The atomic structure of calcium-silicate-hydrate (C1.67-S-Hx) has been investigated by theoretical methods in Received 13 February 2014 order to establish a better insight into its structure. Three models for C-S-H all derived from tobermorite are pro- Accepted 12 September 2014 posed and a large number of structures were created within each model by making a random distribution of silica Available online xxxx oligomers of different size within each structure. These structures were subjected to structural relaxation by ge- ometry optimization and molecular dynamics steps. That resulted in a set of energies within each model. Despite Keywords: an energy distribution between individual structures within each model, significant energy differences are Calcium-Silicate-Hydrate (C-S-H) (B) Crystal Structure (B) observed between the three models. The C-S-H model related to the lowest energy is considered as the most Atomistic simulation probable. It turns out to be characterized by the distribution of dimeric and pentameric silicates and the absence of monomers.
    [Show full text]
  • Brownmillerite Ca2(Al, Fe )2O5 C 2001-2005 Mineral Data Publishing, Version 1
    3+ Brownmillerite Ca2(Al, Fe )2O5 c 2001-2005 Mineral Data Publishing, version 1 Crystal Data: Orthorhombic. Point Group: mm2. As square platelets, to about 60 µm; massive. Physical Properties: Hardness = n.d. D(meas.) = 3.76 D(calc.) = 3.68–3.73 Optical Properties: Semitransparent. Color: Reddish brown. Optical Class: Biaxial (–). Pleochroism: Distinct; X = Y = yellow-brown; Z = dark brown. Orientation: Y and Z lie in the plane of the platelets; extinction in that plane is diagonal. α = < 2.02 β = > 2.02 γ = > 2.02 2V(meas.) = n.d. Cell Data: Space Group: Ibm2. a = 5.584(5) b = 14.60(1) c = 5.374(5) Z = 2 X-ray Powder Pattern: Near Mayen, Germany. 2.65 (vs), 7.19 (s), 2.78 (s), 1.93 (s), 2.05 (ms), 3.65 (m), 1.82 (m) Chemistry: (1) (2) (3) TiO2 1.5 1.9 Al2O3 17.2 22.3 13.1 Fe2O3 30.5 27.6 41.9 Cr2O3 0.1 n.d. MgO n.d. n.d. CaO 46.2 44.8 43.7 insol. 4.0 LOI 0.5 Total 94.4 100.3 100.6 (1) Near Mayen, Germany; by semiquantitative spectroscopy. (2) Hatrurim Formation, Israel; corresponds to Ca1.99(Al1.09Fe0.86Ti0.05)Σ=2.00O5. (3) Do.; corresponds to Ca1.95(Fe1.31Al0.64 Ti0.06)Σ=2.01O5. Occurrence: In thermally metamorphosed limestone blocks included in volcanic rocks (near Mayen, Germany); in high-temperature, thermally metamorphosed, impure limestones (Hatrurim Formation, Israel). Association: Calcite, ettringite, wollastonite, larnite, mayenite, gehlenite, diopside, pyrrhotite, grossular, spinel, afwillite, jennite, portlandite, jasmundite (near Mayen, Germany); melilite, mayenite, wollastonite, kalsilite, corundum (Kl¨och, Austria); spurrite, larnite, mayenite (Hatrurim Formation, Israel).
    [Show full text]
  • Bentorite Ca6(Cr, Al)2(SO4)3(OH)12 • 26H2O C 2001-2005 Mineral Data Publishing, Version 1
    Bentorite Ca6(Cr, Al)2(SO4)3(OH)12 • 26H2O c 2001-2005 Mineral Data Publishing, version 1 Crystal Data: Hexagonal. Point Group: 6/m 2/m 2/m. As stout hexagonal prisms, {1010}, {1011}, {0001}, to 0.25 mm; commonly in fibrous masses, granular aggregates, and thin films. Twinning: On {1010} as composition plane. Physical Properties: Cleavage: {1010}, perfect; {0001}, distinct. Hardness = 2 D(meas.) = 2.025 D(calc.) = 2.021 Optical Properties: Transparent. Color: Bright violet. Streak: Very pale violet. Luster: Vitreous. Optical Class: Uniaxial (+). Pleochroism: O = nearly colorless; E = pale violet. Absorption: O < E. ω = 1.478(2) = 1.484(2) Cell Data: Space Group: P 63/mmc. a = 22.35 c = 21.41 Z = 8 X-ray Powder Pattern: Hatrurim Formation, Israel. 9.656 (100), 5.592 (40), 1.942 (20), 3.60 (10), 3.23 (10), 2.772 (10), 3.89 (8) Chemistry: (1) SO3 14.99 CO2 6.70 SiO2 2.50 Al2O3 1.01 Fe2O3 0.10 Cr2O3 7.48 MgO 0.00 CaO 29.90 H2O 37.70 Total 100.38 (1) Hatrurim Formation, Israel; by AA, SO3 by gravimetric analysis, CO2 and H2O by TGA; after deduction of CaO and CO2 as calcite and CaO, SiO2, H2O as truscottite, the remainder 3+ • (about 80%) corresponds to Ca5.88(Cr1.61Al0.32Fe0.02)Σ=1.95(S1.02O4)3.00(OH)11.97 28.06H2O. Mineral Group: Ettringite group. Occurrence: In low-temperature hydrothermal veins in black calcite–spurrite marble. Association: Calcite, thaumasite, truscottite, vaterite, jennite, tobermorite, brownmillerite, mayenite, melnikovite, “chlorite”. Distribution: In a marble quarry in the Hatrurim Formation, near the Arad-Sodom road, Negev Desert, Israel.
    [Show full text]
  • Mayenite Ca12al14o33 C 2001-2005 Mineral Data Publishing, Version 1
    Mayenite Ca12Al14O33 c 2001-2005 Mineral Data Publishing, version 1 Crystal Data: Cubic. Point Group: 43m (synthetic). In rounded anhedral grains, to 60 µm. Physical Properties: Hardness = n.d. D(meas.) = 2.85 D(calc.) = [2.67] Alters immediately to hydrated calcium aluminates on exposure to H2O. Optical Properties: Transparent. Color: Colorless. Optical Class: Isotropic. n = 1.614–1.643 Cell Data: Space Group: I43d (synthetic). a = 11.97–12.02 Z = 2 X-ray Powder Pattern: Near Mayen, Germany. 2.69 (vs), 4.91 (s), 2.45 (ms), 3.00 (m), 2.19 (m), 1.95 (m), 1.66 (m) Chemistry: (1) (2) (3) SiO2 0.4 Al2O3 45.2 49.5 51.47 Fe2O3 2.0 1.5 MnO 1.4 CaO 45.7 47.0 48.53 LOI 2.2 Total 95.1 99.8 100.00 (1) Near Mayen, Germany; by semiquantitative spectroscopy. (2) Hatrurim Formation, Israel; by electron microprobe, corresponding to (Ca11.7Mg0.5)Σ=12.2(Al13.5Fe0.25Si0.10)Σ=13.85O33. (3) Ca12Al14O33. Occurrence: In thermally metamorphosed limestone blocks included in volcanic rocks (near Mayen, Germany); common in high-temperature, thermally metamorphosed, impure limestones (Hatrurim Formation, Israel). Association: Calcite, ettringite, wollastonite, larnite, brownmillerite, gehlenite, diopside, pyrrhotite, grossular, spinel, afwillite, jennite, portlandite, jasmundite (near Mayen, Germany); melilite, wollastonite, kalsilite, brownmillerite, corundum (Kl¨och, Austria); spurrite, larnite, grossite, brownmillerite (Hatrurim Formation, Israel). Distribution: From the Ettringer-Bellerberg volcano, near Mayen, Eifel district, Germany. Found at Kl¨och, Styria, Austria. In the Hatrurim Formation, Israel. From Kopeysk, Chelyabinsk coal basin, Southern Ural Mountains, Russia. Name: For Mayen, Germany, near where the mineral was first described.
    [Show full text]
  • Wollastonite Paper Revised -Symplectic.Pdf
    This is a repository copy of Thermal stability of C-S-H phases and applicability of Richardson and Groves’ and Richardson C-(A)-S-H(I) models to synthetic C-S-H. White Rose Research Online URL for this paper: http://eprints.whiterose.ac.uk/109873/ Version: Accepted Version Article: Rodriguez, ET, Garbev, K, Merz, D et al. (2 more authors) (2017) Thermal stability of C-S-H phases and applicability of Richardson and Groves’ and Richardson C-(A)-S-H(I) models to synthetic C-S-H. Cement and Concrete Research, 93. pp. 45-56. ISSN 0008-8846 https://doi.org/10.1016/j.cemconres.2016.12.005 © 2016 Published by Elsevier Ltd. Licensed under the Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International http://creativecommons.org/licenses/by-nc-nd/4.0/ Reuse Unless indicated otherwise, fulltext items are protected by copyright with all rights reserved. The copyright exception in section 29 of the Copyright, Designs and Patents Act 1988 allows the making of a single copy solely for the purpose of non-commercial research or private study within the limits of fair dealing. The publisher or other rights-holder may allow further reproduction and re-use of this version - refer to the White Rose Research Online record for this item. Where records identify the publisher as the copyright holder, users can verify any specific terms of use on the publisher’s website. Takedown If you consider content in White Rose Research Online to be in breach of UK law, please notify us by emailing [email protected] including the URL of the record and the reason for the withdrawal request.
    [Show full text]
  • Calcium-Aluminum-Silicate-Hydrate “
    Cent. Eur. J. Geosci. • 2(2) • 2010 • 175-187 DOI: 10.2478/v10085-010-0007-6 Central European Journal of Geosciences Calcium-aluminum-silicate-hydrate “cement” phases and rare Ca-zeolite association at Colle Fabbri, Central Italy Research Article F. Stoppa1∗, F. Scordari2,E.Mesto2, V.V. Sharygin3, G. Bortolozzi4 1 Dipartimento di Scienze della Terra, Università G. d’Annunzio, Chieti, Italy 2 Dipartimento Geomineralogico, Università di Bari, Bari, Italy 3 Sobolev V.S. Institute of Geology and Mineralogy, Siberian Branch of the Russian Academy of Sciences, Novosibirsk 630090, Russia 4 Via Dogali, 20, 31100-Treviso Received 26 January 2010; accepted 8 April 2010 Abstract: Very high temperature, Ca-rich alkaline magma intruded an argillite formation at Colle Fabbri, Central Italy, producing cordierite-tridymite metamorphism in the country rocks. An intense Ba-rich sulphate-carbonate- alkaline hydrothermal plume produced a zone of mineralization several meters thick around the igneous body. Reaction of hydrothermal fluids with country rocks formed calcium-silicate-hydrate (CSH), i.e., tobermorite- afwillite-jennite; calcium-aluminum-silicate-hydrate (CASH) – “cement” phases – i.e., thaumasite, strätlingite and an ettringite-like phase and several different species of zeolites: chabazite-Ca, willhendersonite, gismon- dine, three phases bearing Ca with the same or perhaps lower symmetry of phillipsite-Ca, levyne-Ca and the Ca-rich analogue of merlinoite. In addition, apophyllite-(KF) and/or apophyllite-(KOH), Ca-Ba-carbonates, portlandite and sulphates were present. A new polymorph from the pyrrhotite group, containing three layers of sphalerite-type structure in the unit cell, is reported for the first time. Such a complex association is unique.
    [Show full text]
  • Structure of Nanocrystalline Calcium Silicate Hydrates
    Structure of nanocrystalline calcium silicate hydrates: insights from X-ray diffraction, synchrotron X-ray absorption and nuclear magnetic resonance Sylvain Grangeon, Francis Claret, Cédric Roosz, Tsutomu Sato, Stéphane Gaboreau, Yannick Linard To cite this version: Sylvain Grangeon, Francis Claret, Cédric Roosz, Tsutomu Sato, Stéphane Gaboreau, et al.. Struc- ture of nanocrystalline calcium silicate hydrates: insights from X-ray diffraction, synchrotron X-ray absorption and nuclear magnetic resonance. Journal of Applied Crystallography, International Union of Crystallography, 2016, 49 (3), pp.771 - 783. 10.1107/S1600576716003885. hal-01695800 HAL Id: hal-01695800 https://hal-brgm.archives-ouvertes.fr/hal-01695800 Submitted on 29 Jan 2018 HAL is a multi-disciplinary open access L’archive ouverte pluridisciplinaire HAL, est archive for the deposit and dissemination of sci- destinée au dépôt et à la diffusion de documents entific research documents, whether they are pub- scientifiques de niveau recherche, publiés ou non, lished or not. The documents may come from émanant des établissements d’enseignement et de teaching and research institutions in France or recherche français ou étrangers, des laboratoires abroad, or from public or private research centers. publics ou privés. research papers Structure of nanocrystalline calcium silicate hydrates: insights from X-ray diffraction, synchrotron X-ray absorption and nuclear ISSN 1600-5767 magnetic resonance Sylvain Grangeon,a* Francis Claret,a Ce´dric Roosz,a,b Tsutomu Sato,c Ste´phane a d Received 15 September 2015 Gaboreau and Yannick Linard Accepted 7 March 2016 aD3E/SVP, BRGM (French Geological Survey), 3 avenue Claude Guillemin, Orle´ans, 45060, France, bScientific Division, Andra, 1–7 rue Jean Monnet, Parc de la Croix Blanche, Chaˆtenay-Malabry, France, cLaboratory of Environmental Edited by Th.
    [Show full text]
  • Molecular Dynamics Simulation of Calcium-Silicate-Hydrate for Nano-Engineered Cement Composites—A Review
    nanomaterials Review Molecular Dynamics Simulation of Calcium-Silicate-Hydrate for Nano-Engineered Cement Composites—A Review Byoung Hooi Cho 1 , Wonseok Chung 2,* and Boo Hyun Nam 1,* 1 Department of Civil, Environmental and Construction Engineering, University of Central Florida, 12800 Pegasus Drive, Suite 211, Orlando, FL 32816, USA; [email protected] 2 Department of Civil Engineering, Kyung Hee University, 1732 Deogyeong-daero, Giheung-gu, Yongin-si 17104, Korea * Correspondence: [email protected] (W.C.); [email protected] (B.H.N.) Received: 17 September 2020; Accepted: 20 October 2020; Published: 29 October 2020 Abstract: With the continuous research efforts, sophisticated predictive molecular dynamics (MD) models for C-S-H have been developed, and the application of MD simulation has been expanded from fundamental understanding of C-S-H to nano-engineered cement composites. This paper comprehensively reviewed the current state of MD simulation on calcium-silicate-hydrate (C-S-H) and its diverse applications to nano-engineered cement composites, including carbon-based nanomaterials (i.e., carbon nanotube, graphene, graphene oxide), reinforced cement, cement–polymer nanocomposites (with an application on 3D printing concrete), and chemical additives for improving environmental resistance. In conclusion, the MD method could not only compute but also visualize the nanoscale behaviors of cement hydrates and other ingredients in the cement matrix; thus, fundamental properties of C-S-H structure and its interaction with nanoparticles can be well understood. As a result, the MD enabled us to identify and evaluate the performance of new advanced nano-engineered cement composites. Keywords: molecular dynamics; calcium-silicate-hydrate; nano-engineered cement materials; carbon-based nanomaterials; cement–polymer nanocomposites 1.
    [Show full text]
  • Jennite Ca9h2si6o18(OH)8 ² 6H2O C 2001 Mineral Data Publishing, Version 1.2 ° Crystal Data: Triclinic
    Jennite Ca9H2Si6O18(OH)8 ² 6H2O c 2001 Mineral Data Publishing, version 1.2 ° Crystal Data: Triclinic. Point Group: 1 or 1: As blade-shaped crystals, elongated along [010], to 6 mm, or as ¯brous aggregates. Physical Properties: Cleavage: Distinct on 001 . Hardness = n.d. D(meas.) = 2.32{2.33 D(calc.) = [2.34] f g Optical Properties: Transparent to translucent. Color: White; colorless in thin section. Luster: Vitreous. Optical Class: Biaxial ({). Orientation: X 001 cleavage; Y b = 35±{40±. ? f g ^ ® = 1.548{1.552 ¯ = 1.562{1.564 ° = 1.570{1.571 2V(meas.) = 74± Cell Data: Space Group: P 1 or P 1: a = 10.56 b = 7.25 c = 10.81 ® = 99±420 ¯ = 97±420 ° = 110±40 Z = 1 X-ray Powder Pattern: Crestmore, California, USA. 10.5 (vvs), 2.92 (vs), 3.04 (s), 2.83 (s), 2.66 (s), 6.46 (ms), 3.47 (ms) Chemistry: (1) (2) (1) (2) SiO2 34.2 33.20 Na2O 0.00 TiO2 0.02 K2O 0.01 + Al2O3 0.09 H2O 18.53 FeO 0.01 H2O¡ 1.69 MnO 0.02 H2O 19.2 MgO 0.03 P2O5 0.04 CaO 46.6 46.85 Total 100.0 100.49 (1) Crestmore, California, USA; by electron microprobe; H2O by TGA; corresponds to Ca8:76H2:00 Si6:00O17:76(OH)8:00 ² 6:24H2O: (2) Fuka, Japan; by electron microprobe, H2O by gravimetry; corresponds to Ca9:00H2:00(Si5:95Al0:02)§=5:97O17:93(OH)8:00 ² 6:07H2O: Occurrence: A late-stage mineral, partially ¯lling open spaces and in veins in fractured skarns.
    [Show full text]
  • Cementitious Phases
    CEMENTITIOUS PHASES In the context of waste confinement and, more specifically, waste from the nuclear industry, concrete is used both as a confinement and a building material. High-level long lived radwaste and some of the intermediate level wastes are exothermic (e.g. compacted hulls and endspecies) and then, temperature exposure of concrete backfill and packages must be considered. The present work aims at defining the solubility constants of the minerals that compose cement pastes, based on the most recent works on this subject and in agreement with the Thermochimie data base. Data selection takes into consideration a range of temperatures from 10 to 100°C. This implies to develop a thermodynamic database complete enough in terms of mineral phases. This also implies to focus the selection not only on the equilibrium constants but on the enthalpy of formation and the heat capacity of each mineral. The chemical system investigated is a complex one, CaO-SiO -Al O -MgO-Fe O -CO -SO -Cl-H O. This 2 2 3 2 3 2 3 2 includes nanocrystalline and crystalline C-S-H phases and accessory cementitious mineral such as ettringite or katoite, for example. In summary, a solubility model for cement phases is proposed in Thermochimie because: - cement is a key material for containment barriers - available models still carry on problems concerning katoite, monosulfoaluminates - available models are not consistent with Thermochimie 1 PRELIMINARY ASPECTS OF THE SELECTION PROCEDURE 1.1 SELECTION GUIDELINES The selection for thermodynamic properties of cementitious minerals is proceeds following different guidelines : - when possible, we avoid fitting LogK(T) functions, as well as averaging equilibrium constants.
    [Show full text]
  • JENNITE, a NEW MINERAL Abcqnpbnrort, Department Oj
    THE AMERICAN MINERALOGIST, VOL. 51, JANUARY FEBRUARY, 1966 JENNITE, A NEW MINERAL A. B. C.q.npBNrort,Department oJ Geology' Uni,tters'ity of Missouri,Columbia, Missowri; R. A. Cu.q'mons,J' A' Genl, K. Spnexu.q'NAND H. F. W. Tavron, Department of Chemistry, Ltniaersityof Aberdeen,Scotland,. Aesrnact of approrimate composition Jennite is a neu' mineraL from Crestmore, California, NazCaiSi;O:oHn.Itistriclinic,witho:10.56,b:725,c:108i A,a:99"42',8:97o40', y:110o04,, Z:1.It forms blade-shaped crystals I'ith length 6 and cleavage (001). The -74'; refractive indices are q:7.552, 9:1.564, t:l'571; 2V (calc.): aA(001):90', discovererof the mineral. INtnoouctroN The contact rocks at Crestmore, California were first describedb1' Eakle (1917). Man1, subsequentinvestigations on them have been re- ported; Murdoch (1961)has given a recent survey''Ihe object of the presentpaper is to describea nelv mineral found at this locality by Col- at the onel C. M. Jenni, who is now director of the geologicalmuseum university of \Iissouri. The chemicalcomposition, f-ray powder pattern, and other data for this mineral show that it is a new species,and the name jennite is proposedin honor of its discoverer. Occunnoxco open spacesin Jennite occurs as a late-stagemineral partially filling f ractured calcite-monticellite-hercyniteand vesuvianite-lvollastonite contact rock at Crestmore.The monticellite has been altered to serpen- tine plus calcitefor five or more centimeterson either sideof the fractures although the rvollastonitein the vesuvianite-wollastoniterock has been and is unaff".t"d. Jennite is alwal-s associatedwith 14 A tobermorite occasionallyfound with scawtiteand calcite.Scawtite and calciteare the earliestminerals in the fractures and may be encrustedby 14 A tober- morite, jennite or both.
    [Show full text]